tetrakis(prop-2-enyl)phosphanium iodide

C12H20IP — CID 87197192

IUPACtetrakis(prop-2-enyl)phosphanium iodide
SMILESC=CC[P+](CC=C)(CC=C)CC=C.[I-]
InChIInChI=1S/C12H20P.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-8H,1-4,9-12H2;1H/q+1;/p-1
InChIKeyLJGIAYZMTBFVCT-UHFFFAOYSA-M
MW322.17 g/mol
LogP0.75
Rot. Bonds8

About tetrakis(prop-2-enyl)phosphanium iodide

tetrakis(prop-2-enyl)phosphanium iodide (PubChem CID 87197192) has the molecular formula C12H20IP and a molecular weight of 322.17 g/mol. Its IUPAC name is tetrakis(prop-2-enyl)phosphanium iodide.

Molecular Properties

Compound Nametetrakis(prop-2-enyl)phosphanium iodide
PubChem CID87197192
Molecular FormulaC12H20IP
Molecular Weight322.17 g/mol
Exact Mass322.03
IUPAC Nametetrakis(prop-2-enyl)phosphanium iodide
SMILESC=CC[P+](CC=C)(CC=C)CC=C.[I-]
InChIInChI=1S/C12H20P.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-8H,1-4,9-12H2;1H/q+1;/p-1
InChIKeyLJGIAYZMTBFVCT-UHFFFAOYSA-M
XLogP0.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.17
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

tetrakis(prop-2-enyl)phosphanium acetate
CID 87134475
CID 154594606
CID 154594606
benzyl-tris(prop-2-enyl)phosphanium
CID 66801422
benzyl-tris(prop-2-enyl)phosphanium;ethene
CID 174788600
CID 18417202
CID 18417202
(4S)-5-iodo-4-methylpent-1-ene
CID 101059144
CID 88808793
CID 88808793
4-propan-2-ylhepta-1,6-diene
CID 14140894
4-iodopent-1-ene
CID 13244562
4-hepta-1,6-dien-4-yloxyhepta-1,6-diene
CID 23055063
(4S)-4-iodopent-1-ene
CID 88562936
2-(1-hydroxyethenyl)pent-4-enoic acid
CID 173039321

Frequently Asked Questions

What is the IUPAC name of tetrakis(prop-2-enyl)phosphanium iodide?
The IUPAC name of tetrakis(prop-2-enyl)phosphanium iodide (CID 87197192) is tetrakis(prop-2-enyl)phosphanium iodide.
What is the SMILES notation for tetrakis(prop-2-enyl)phosphanium iodide?
The canonical SMILES for tetrakis(prop-2-enyl)phosphanium iodide is C=CC[P+](CC=C)(CC=C)CC=C.[I-].
What is the InChIKey of tetrakis(prop-2-enyl)phosphanium iodide?
The InChIKey is LJGIAYZMTBFVCT-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H20P.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-8H,1-4,9-12H2;1H/q+1;/p-1.
What are the key properties of tetrakis(prop-2-enyl)phosphanium iodide?
tetrakis(prop-2-enyl)phosphanium iodide has a molecular weight of 322.17 g/mol, XLogP of 0.75, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(prop-2-enyl)phosphanium iodide is sourced from PubChem (CID 87197192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).